7-hydroxy-6-quinolin-2-ylcyclopenta[c]pyridin-2-ium-5-one

C17H11N2O2+ — CID 4621471

IUPAC7-hydroxy-6-quinolin-2-ylcyclopenta[c]pyridin-2-ium-5-one
SMILESO=C1C(c2ccc3ccccc3n2)=C(O)c2c[nH+]ccc21
InChIInChI=1S/C17H10N2O2/c20-16-11-7-8-18-9-12(11)17(21)15(16)14-6-5-10-3-1-2-4-13(10)19-14/h1-9,21H/p+1
InChIKeyGJJLGPPPDNSFOL-UHFFFAOYSA-O
MW275.29 g/mol
LogP2.67
Rot. Bonds1

About 7-hydroxy-6-quinolin-2-ylcyclopenta[c]pyridin-2-ium-5-one

7-hydroxy-6-quinolin-2-ylcyclopenta[c]pyridin-2-ium-5-one (PubChem CID 4621471) has the molecular formula C17H11N2O2+ and a molecular weight of 275.29 g/mol. Its IUPAC name is 7-hydroxy-6-quinolin-2-ylcyclopenta[c]pyridin-2-ium-5-one.

Molecular Properties

Compound Name7-hydroxy-6-quinolin-2-ylcyclopenta[c]pyridin-2-ium-5-one
PubChem CID4621471
Molecular FormulaC17H11N2O2+
Molecular Weight275.29 g/mol
Exact Mass275.08
IUPAC Name7-hydroxy-6-quinolin-2-ylcyclopenta[c]pyridin-2-ium-5-one
SMILESO=C1C(c2ccc3ccccc3n2)=C(O)c2c[nH+]ccc21
InChIInChI=1S/C17H10N2O2/c20-16-11-7-8-18-9-12(11)17(21)15(16)14-6-5-10-3-1-2-4-13(10)19-14/h1-9,21H/p+1
InChIKeyGJJLGPPPDNSFOL-UHFFFAOYSA-O
XLogP2.67
TPSA64.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.29
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-hydroxy-2-[6-(4-methylphenyl)quinolin-2-yl]inden-1-one
CID 2755366
3-[dimethyl(phenyl)silyl]oxy-2-quinolin-2-ylinden-1-one
CID 20702897
5-bromo-4-hydroxy-2-quinolin-2-yl-1H-pyrimidin-6-one
CID 66284746
3-hydroxy-2-quinolin-4-ylinden-1-one
CID 3135549
2-[2-(sulfinoamino)phenyl]quinoline
CID 22445092
2-(4-quinolin-2-yl-1H-pyrrol-3-yl)quinoline
CID 54524072
3-hydroxy-2-pyrimidin-4-ylinden-1-one
CID 135507037
2-methyl-3-quinolin-2-ylcyclopent-2-en-1-one
CID 142684141
iridium;tris(2-phenylquinoline)
CID 122129463
2-(2-fluorophenyl)quinoline
CID 11622684
2-quinolin-2-ylquinoline-3-carbonyl chloride
CID 175755817
diphenyl-(2-quinolin-2-ylphenyl)methanol
CID 156790156

Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-6-quinolin-2-ylcyclopenta[c]pyridin-2-ium-5-one?
The IUPAC name of 7-hydroxy-6-quinolin-2-ylcyclopenta[c]pyridin-2-ium-5-one (CID 4621471) is 7-hydroxy-6-quinolin-2-ylcyclopenta[c]pyridin-2-ium-5-one.
What is the SMILES notation for 7-hydroxy-6-quinolin-2-ylcyclopenta[c]pyridin-2-ium-5-one?
The canonical SMILES for 7-hydroxy-6-quinolin-2-ylcyclopenta[c]pyridin-2-ium-5-one is O=C1C(c2ccc3ccccc3n2)=C(O)c2c[nH+]ccc21.
What is the InChIKey of 7-hydroxy-6-quinolin-2-ylcyclopenta[c]pyridin-2-ium-5-one?
The InChIKey is GJJLGPPPDNSFOL-UHFFFAOYSA-O. The full InChI is InChI=1S/C17H10N2O2/c20-16-11-7-8-18-9-12(11)17(21)15(16)14-6-5-10-3-1-2-4-13(10)19-14/h1-9,21H/p+1.
What are the key properties of 7-hydroxy-6-quinolin-2-ylcyclopenta[c]pyridin-2-ium-5-one?
7-hydroxy-6-quinolin-2-ylcyclopenta[c]pyridin-2-ium-5-one has a molecular weight of 275.29 g/mol, XLogP of 2.67, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-6-quinolin-2-ylcyclopenta[c]pyridin-2-ium-5-one is sourced from PubChem (CID 4621471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).